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Receptor

PDB id	Resolution	Class	Description	Source	Keywords
5E3D	1.71 Å	NON-ENZYME: OTHER	CRYSTAL STRUCTURE OF THE HUMAN BRPF1 BROMODOMAIN IN COMPLEX	HOMO SAPIENS	BROMODOMAIN AND PHD FINGER-CONTAINING PROTEIN 1(BRPF1) MONOLEUKEMIA ZINC-FINGER (MOZ) INHIBITOR TRANSCRIPTION DNA BPROTEIN
Ref.:	TWENTY CRYSTAL STRUCTURES OF BROMODOMAIN AND PHD FI CONTAINING PROTEIN 1 (BRPF1)/LIGAND COMPLEXES REVEA CONSERVED BINDING MOTIFS AND RARE INTERACTIONS. J.MED.CHEM. V. 59 5555 2016

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	NGL Viewer	Molecular Weight (Da)	Formula	SMILES
NO3	A:802;	Invalid;	none;	submit data		62.005	N O3	[N+](...
5JL	A:801;	Valid;	none;	Kd = 95 uM		200.241	C5 H4 N4 O S2	C12=C...

View in 3D viewer

90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
4UYE	1.65 Å	NON-ENZYME: OTHER	BROMODOMAIN OF HUMAN BRPF1 WITH N-1,3-DIMETHYL-2-OXO-6-( PIPERIDIN-1-YL)-2,3-DIHYDRO-1H-1,3-BENZODIAZOL-5-YL-2- M ETHOXYBENZAMIDE	HOMO SAPIENS	TRANSCRIPTION INHIBITOR HISTONE EPIGENETIC READER ANTAGO
Ref.:	1,3-DIMETHYL BENZIMIDAZOLONES ARE POTENT, SELECTIVE INHIBITORS OF THE BRPF1 BROMODOMAIN. ACS MED.CHEM.LETT. V. 5 1190 2014

Members (37)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1610 families.
1	5E3G	-	5JQ	C5 H4 N4 O2 S	C12=C(NC(=....
2	5T4U	ic50 = 4800 nM	12Q	C10 H9 N O	CN1c2ccccc....
3	5EWH	Kd = 170 uM	5SG	C9 H7 N O	c1cc2cnccc....
4	5C85	Kd = 105 uM	4YO	C8 H7 Br N2 O	c1cc2c(cc1....
5	5E3D	Kd = 95 uM	5JL	C5 H4 N4 O S2	C12=C(NC(=....
6	5C87	-	4YS	C9 H7 N O	c1ccc2c(c1....
7	5O4T	-	9KT	C10 H10 N2 O2	CN1c2ccccc....
8	5OV8	Kd = 18 uM	AXN	C24 H30 N4 O4 S	CC(C)Cc1cc....
9	5O4S	ic50 = 3.4 uM	9KW	C24 H28 N4 O5 S	CN1c2cc(c(....
10	5MWH	Kd = 1.8 uM	UWX	C24 H30 N4 O5 S	CC(C)Cc1cc....
11	5DY7	-	5GT	C9 H7 F3 N2 O	c1cc2c(cc1....
12	5T4V	ic50 = 60 nM	N48	C19 H17 N3 O4 S	CC1=CC(=O)....
13	5DYC	-	5GU	C8 H7 Br N2 O	c1cc2c(cc1....
14	5O55	-	9L5	C19 H23 N5 O2	CCN1c2ccc(....
15	5EQ1	Kd = 21 uM	BEA	C9 H8 N3 S	Cc1cccc2c1....
16	5G4S	ic50 = 1 uM	8VI	C24 H31 N5 O3	CCN(c1cc2c....
17	5EWC	-	5SJ	C12 H14 N2 O3	CCOC(=O)c1....
18	5EPR	Kd = 91 uM	5QY	C9 H10 N2 O	C[C@H]1C(=....
19	5EVA	-	5S9	C11 H9 F2 N3 O	Cn1c(ccn1)....
20	5ETD	-	5RN	C10 H9 N O	CC(=O)c1c[....
21	5DYA	-	5GV	C11 H12 N2 O3	CC[C@@H]1C....
22	5EV9	-	5SB	C14 H12 N4 O	CC(=O)Nc1c....
23	5MYG	Kd = 31 nM	LS8	C19 H17 N3 O4 S	CC1=Cc2cc(....
24	5MWZ	Kd = 7.1 uM	KGU	C24 H36 N6 O3	CCN1c2cc(c....
25	5G4R	ic50 = 7.943 nM	LF1	C22 H27 N5 O3	C[C@@H]1CN....
26	5OWA	Kd = 3.5 uM	B0H	C17 H24 N4 O2 S	Cc1c(oc(n1....
27	5EM3	-	5Q0	C9 H7 N O	c1cc2c(ccc....
28	5ETB	Kd = 29 uM	5RO	C11 H11 N O	Cc1cccc2c1....
29	4UYE	Kd = 9.54 nM	9F9	C22 H26 N4 O3	CN1c2cc(c(....
30	5O5F	-	9LT	C22 H20 F N5 O3	CCN1c2ccc(....
31	5O5A	-	9LN	C22 H21 N5 O3	CCN1c2ccc(....
32	5O5H	-	9LK	C17 H14 Cl N3 O3	Cc1c(oc(n1....
33	5C7N	Kd = 0.27 uM	BMF	C17 H20 N6 O4 S	CCOC(=O)Nc....
34	5EPS	Kd = 38 uM	5QX	C9 H10 N2 O	CN1c2ccccc....
35	5MWG	ic50 = 1.7 uM	WGX	C25 H30 N4 O4 S	CN1c2cc(c(....
36	5D7X	Kd = 15 uM	XZ8	C14 H13 N3 O2	CC1=C(C(=O....
37	6EKQ	Kd = 10.9 uM	B0H	C17 H24 N4 O2 S	Cc1c(oc(n1....

70% Homology Family (39)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1331 families.
1	5E3G	-	5JQ	C5 H4 N4 O2 S	C12=C(NC(=....
2	5T4U	ic50 = 4800 nM	12Q	C10 H9 N O	CN1c2ccccc....
3	5EWH	Kd = 170 uM	5SG	C9 H7 N O	c1cc2cnccc....
4	5C85	Kd = 105 uM	4YO	C8 H7 Br N2 O	c1cc2c(cc1....
5	5E3D	Kd = 95 uM	5JL	C5 H4 N4 O S2	C12=C(NC(=....
6	5C87	-	4YS	C9 H7 N O	c1ccc2c(c1....
7	5O4T	-	9KT	C10 H10 N2 O2	CN1c2ccccc....
8	5OV8	Kd = 18 uM	AXN	C24 H30 N4 O4 S	CC(C)Cc1cc....
9	5O4S	ic50 = 3.4 uM	9KW	C24 H28 N4 O5 S	CN1c2cc(c(....
10	5MWH	Kd = 1.8 uM	UWX	C24 H30 N4 O5 S	CC(C)Cc1cc....
11	5DY7	-	5GT	C9 H7 F3 N2 O	c1cc2c(cc1....
12	5T4V	ic50 = 60 nM	N48	C19 H17 N3 O4 S	CC1=CC(=O)....
13	5DYC	-	5GU	C8 H7 Br N2 O	c1cc2c(cc1....
14	5O55	-	9L5	C19 H23 N5 O2	CCN1c2ccc(....
15	5EQ1	Kd = 21 uM	BEA	C9 H8 N3 S	Cc1cccc2c1....
16	5G4S	ic50 = 1 uM	8VI	C24 H31 N5 O3	CCN(c1cc2c....
17	5EWC	-	5SJ	C12 H14 N2 O3	CCOC(=O)c1....
18	5EPR	Kd = 91 uM	5QY	C9 H10 N2 O	C[C@H]1C(=....
19	5EVA	-	5S9	C11 H9 F2 N3 O	Cn1c(ccn1)....
20	5ETD	-	5RN	C10 H9 N O	CC(=O)c1c[....
21	5DYA	-	5GV	C11 H12 N2 O3	CC[C@@H]1C....
22	5EV9	-	5SB	C14 H12 N4 O	CC(=O)Nc1c....
23	5MYG	Kd = 31 nM	LS8	C19 H17 N3 O4 S	CC1=Cc2cc(....
24	5MWZ	Kd = 7.1 uM	KGU	C24 H36 N6 O3	CCN1c2cc(c....
25	5G4R	ic50 = 7.943 nM	LF1	C22 H27 N5 O3	C[C@@H]1CN....
26	5OWA	Kd = 3.5 uM	B0H	C17 H24 N4 O2 S	Cc1c(oc(n1....
27	5EM3	-	5Q0	C9 H7 N O	c1cc2c(ccc....
28	5ETB	Kd = 29 uM	5RO	C11 H11 N O	Cc1cccc2c1....
29	4UYE	Kd = 9.54 nM	9F9	C22 H26 N4 O3	CN1c2cc(c(....
30	5O5F	-	9LT	C22 H20 F N5 O3	CCN1c2ccc(....
31	5O5A	-	9LN	C22 H21 N5 O3	CCN1c2ccc(....
32	5O5H	-	9LK	C17 H14 Cl N3 O3	Cc1c(oc(n1....
33	5C7N	Kd = 0.27 uM	BMF	C17 H20 N6 O4 S	CCOC(=O)Nc....
34	5EPS	Kd = 38 uM	5QX	C9 H10 N2 O	CN1c2ccccc....
35	5MWG	ic50 = 1.7 uM	WGX	C25 H30 N4 O4 S	CN1c2cc(c(....
36	5D7X	Kd = 15 uM	XZ8	C14 H13 N3 O2	CC1=C(C(=O....
37	6EKQ	Kd = 10.9 uM	B0H	C17 H24 N4 O2 S	Cc1c(oc(n1....
38	3RCW	-	MB3	C5 H9 N O	CN1CCCC1=O
39	5N49	ic50 = 450 nM	8LW	C22 H17 N3 O3	Cc1cc2c(cc....

50% Homology Family (64)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1144 families.
1	5I7Y	Kd = 52 nM	69G	C20 H21 N3 O2	C/C=C/CN1C....
2	4UIW	ic50 = 0.00000001 M	H1B	C22 H22 F3 N3 O3 S2	CCN1C=C(c2....
3	4UIV	ic50 = 0.00000001 M	XZB	C21 H20 F3 N3 O3 S2	CN1C=C(c2c....
4	5JI8	Kd = 23.4 uM	6KT	C8 H7 N3 O S	c1cc2c(cc1....
5	5MKY	ic50 = 2 uM	I0D	C15 H17 Cl N4 O	CN1CCc2c(c....
6	4UIU	ic50 = 0.00000001 M	TVU	C22 H24 N2 O6 S2	CN1C=C(c2c....
7	4UIT	ic50 = 0.00000001 M	N1D	C22 H25 N3 O6 S2	CN1C=C(c2c....
8	5I40	ic50 = 13.7 uM	67N	C8 H8 N2 O	CN1C=Cc2cc....
9	5I7X	Kd = 53 nM	67B	C17 H17 N3 O2	CN1C=C(c2c....
10	6V1B	Kd = 37 nM	H1B	C22 H22 F3 N3 O3 S2	CCN1C=C(c2....
11	6V0X	Kd = 277 uM	B49	C22 H27 F N4 O2	CCN(CC)CCN....
12	4XY8	Kd = 397 nM	43U	C12 H10 Br N5 O	COc1ccc(cc....
13	5IGM	Kd = 41.7 nM	BMF	C17 H20 N6 O4 S	CCOC(=O)Nc....
14	4Z6H	Kd = 612 nM	4L2	C16 H18 N2 O2	CC1=CC(=O)....
15	6HM0	Kd = 73 nM	GBW	C50 H64 N8 O9 S	Cc1c(scn1)....
16	5F1H	Kd = 14.1 nM	5U6	C20 H23 N3 O3	CN1C=C(c2c....
17	5F1L	ic50 = 21 nM	5U2	C19 H24 N2 O4	CC1=CC(=CN....
18	5F25	Kd = 9.1 uM	5TU	C14 H14 N2 O2	CC1=CC(=CN....
19	4Z6I	-	4L3	C27 H31 N3 O4	CC1=CC(=O)....
20	6V0S	Kd = 16000 nM	EAE	C13 H15 N O2 S	CCN1c2cc(c....
21	5EU1	Kd = 15.4 nM	5SW	C20 H23 N3 O3	CN1C=C(c2c....
22	6V14	Kd = 82 nM	QMG	C20 H19 N3 O2	Cc1ccc(cc1....
23	5F2P	Kd = 37.5 uM	5TY	C10 H12 N4 O	CN1C=Cc2c(....
24	5E3D	Kd = 95 uM	5JL	C5 H4 N4 O S2	C12=C(NC(=....
25	5C87	-	4YS	C9 H7 N O	c1ccc2c(c1....
26	5O4T	-	9KT	C10 H10 N2 O2	CN1c2ccccc....
27	5OV8	Kd = 18 uM	AXN	C24 H30 N4 O4 S	CC(C)Cc1cc....
28	5O4S	ic50 = 3.4 uM	9KW	C24 H28 N4 O5 S	CN1c2cc(c(....
29	5MWH	Kd = 1.8 uM	UWX	C24 H30 N4 O5 S	CC(C)Cc1cc....
30	5DY7	-	5GT	C9 H7 F3 N2 O	c1cc2c(cc1....
31	5T4V	ic50 = 60 nM	N48	C19 H17 N3 O4 S	CC1=CC(=O)....
32	5DYC	-	5GU	C8 H7 Br N2 O	c1cc2c(cc1....
33	5O55	-	9L5	C19 H23 N5 O2	CCN1c2ccc(....
34	5EQ1	Kd = 21 uM	BEA	C9 H8 N3 S	Cc1cccc2c1....
35	5G4S	ic50 = 1 uM	8VI	C24 H31 N5 O3	CCN(c1cc2c....
36	5EWC	-	5SJ	C12 H14 N2 O3	CCOC(=O)c1....
37	5EPR	Kd = 91 uM	5QY	C9 H10 N2 O	C[C@H]1C(=....
38	5EVA	-	5S9	C11 H9 F2 N3 O	Cn1c(ccn1)....
39	5ETD	-	5RN	C10 H9 N O	CC(=O)c1c[....
40	5DYA	-	5GV	C11 H12 N2 O3	CC[C@@H]1C....
41	5EV9	-	5SB	C14 H12 N4 O	CC(=O)Nc1c....
42	5MYG	Kd = 31 nM	LS8	C19 H17 N3 O4 S	CC1=Cc2cc(....
43	5MWZ	Kd = 7.1 uM	KGU	C24 H36 N6 O3	CCN1c2cc(c....
44	5G4R	ic50 = 7.943 nM	LF1	C22 H27 N5 O3	C[C@@H]1CN....
45	5OWA	Kd = 3.5 uM	B0H	C17 H24 N4 O2 S	Cc1c(oc(n1....
46	5EM3	-	5Q0	C9 H7 N O	c1cc2c(ccc....
47	5ETB	Kd = 29 uM	5RO	C11 H11 N O	Cc1cccc2c1....
48	4UYE	Kd = 9.54 nM	9F9	C22 H26 N4 O3	CN1c2cc(c(....
49	5O5F	-	9LT	C22 H20 F N5 O3	CCN1c2ccc(....
50	5O5A	-	9LN	C22 H21 N5 O3	CCN1c2ccc(....
51	5O5H	-	9LK	C17 H14 Cl N3 O3	Cc1c(oc(n1....
52	5C7N	Kd = 0.27 uM	BMF	C17 H20 N6 O4 S	CCOC(=O)Nc....
53	5EPS	Kd = 38 uM	5QX	C9 H10 N2 O	CN1c2ccccc....
54	5MWG	ic50 = 1.7 uM	WGX	C25 H30 N4 O4 S	CN1c2cc(c(....
55	5D7X	Kd = 15 uM	XZ8	C14 H13 N3 O2	CC1=C(C(=O....
56	6EKQ	Kd = 10.9 uM	B0H	C17 H24 N4 O2 S	Cc1c(oc(n1....
57	6V1E	Kd = 121 nM	5SW	C20 H23 N3 O3	CN1C=C(c2c....
58	6V17	Kd = 148 nM	H1B	C22 H22 F3 N3 O3 S2	CCN1C=C(c2....
59	6V0Q	Kd = 4200 nM	EAE	C13 H15 N O2 S	CCN1c2cc(c....
60	6V1H	Kd = 114 nM	BMF	C17 H20 N6 O4 S	CCOC(=O)Nc....
61	6V16	Kd = 556 nM	QMG	C20 H19 N3 O2	Cc1ccc(cc1....
62	6V1F	Kd = 418 nM	5U6	C20 H23 N3 O3	CN1C=C(c2c....
63	3RCW	-	MB3	C5 H9 N O	CN1CCCC1=O
64	5N49	ic50 = 450 nM	8LW	C22 H17 N3 O3	Cc1cc2c(cc....

Polypharmacology

Similar Ligands (2D)

Ligand no: 1; Ligand: 5JL; Similar ligands found: 3

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	5JL	1	1
2	5JQ	0.617647	0.938776
3	8TX	0.606061	0.92

Similar Ligands (3D)

Ligand no: 1; Ligand: 5JL; Similar ligands found: 1108

No:	Ligand	Similarity coefficient
1	B55	1.0000
2	URC	0.9973
3	XAZ	0.9956
4	75K	0.9942
5	8IG	0.9941
6	BTY	0.9927
7	QBK	0.9871
8	1XM	0.9695
9	9DG	0.9693
10	VGD	0.9687
11	BGC	0.9680
12	GUN	0.9679
13	5VM	0.9673
14	AZA	0.9665
15	MEW	0.9664
16	BOA	0.9660
17	M6N	0.9659
18	Q24	0.9659
19	CWM	0.9658
20	J9W	0.9656
21	YH7	0.9651
22	PE0	0.9643
23	AZ8	0.9641
24	M5K	0.9639
25	36R	0.9626
26	IGA	0.9625
27	ES2	0.9624
28	0FO	0.9621
29	1P8	0.9619
30	AJ2	0.9618
31	141	0.9617
32	MUA	0.9617
33	ES0	0.9614
34	XAN	0.9613
35	CLW	0.9610
36	0CU	0.9605
37	A2F	0.9601
38	ET2	0.9599
39	QX4	0.9599
40	B62	0.9594
41	AQO	0.9591
42	M1Q	0.9591
43	AZG	0.9586
44	Q88	0.9586
45	6AP	0.9577
46	CWJ	0.9575
47	BCP	0.9571
48	4HC	0.9570
49	JA8	0.9565
50	DX4	0.9554
51	GLC	0.9550
52	6GU	0.9549
53	CFP	0.9539
54	290	0.9536
55	OTW	0.9533
56	XHP	0.9533
57	2D0	0.9530
58	KT7	0.9519
59	6VD	0.9515
60	DQU	0.9509
61	HMH	0.9508
62	XQ0	0.9498
63	4ME	0.9496
64	K2T	0.9494
65	FBB	0.9488
66	44W	0.9484
67	2EC	0.9482
68	4MU	0.9469
69	DRL	0.9469
70	MVN	0.9468
71	2AK	0.9462
72	IV2	0.9461
73	AS3	0.9459
74	HH5	0.9451
75	RM1	0.9449
76	S76	0.9438
77	94W	0.9434
78	MS9	0.9433
79	MRW	0.9429
80	G3F	0.9422
81	FYU	0.9420
82	KIB	0.9418
83	A7W	0.9417
84	H42	0.9416
85	EV0	0.9413
86	4HM	0.9412
87	NOJ	0.9412
88	2HQ	0.9410
89	BZ3	0.9410
90	6RQ	0.9409
91	5OB	0.9406
92	4M0	0.9405
93	44V	0.9403
94	ZZT	0.9402
95	FA0	0.9401
96	AX3	0.9401
97	GCS	0.9400
98	6ME	0.9398
99	PQ0	0.9394
100	BHA	0.9393
101	BZX	0.9389
102	DIN	0.9386
103	DOB	0.9385
104	PH2	0.9384
105	JND	0.9383
106	ES9	0.9382
107	2AL	0.9381
108	9MG	0.9379
109	5NU	0.9377
110	7B4	0.9377
111	HQD	0.9376
112	M0Q	0.9376
113	FK1	0.9372
114	M1E	0.9372
115	ODO	0.9370
116	VNL	0.9369
117	H4N	0.9368
118	CWS	0.9368
119	86J	0.9364
120	VK3	0.9364
121	9R5	0.9363
122	2K4	0.9361
123	F60	0.9360
124	5MB	0.9360
125	H33	0.9356
126	11S	0.9356
127	P92	0.9355
128	6AI	0.9355
129	5MI	0.9354
130	0N7	0.9354
131	5CU	0.9352
132	AZ9	0.9352
133	COU	0.9349
134	7VS	0.9349
135	RXA	0.9349
136	J9T	0.9349
137	TWO	0.9349
138	2AQ	0.9348
139	M0W	0.9348
140	0P6	0.9347
141	LZM	0.9345
142	5H1	0.9344
143	8WT	0.9343
144	4FS	0.9342
145	14O	0.9341
146	5Q0	0.9339
147	FDB	0.9339
148	3F0	0.9336
149	4TU	0.9335
150	AX7	0.9335
151	8NY	0.9334
152	O72	0.9333
153	KJU	0.9332
154	3DM	0.9332
155	24W	0.9332
156	NQ	0.9331
157	5SG	0.9330
158	270	0.9329
159	7MU	0.9329
160	OCH	0.9328
161	HQY	0.9328
162	03V	0.9326
163	UEG	0.9326
164	209	0.9323
165	42A	0.9323
166	8S0	0.9323
167	ES5	0.9321
168	5IQ	0.9320
169	EA1	0.9320
170	1SQ	0.9319
171	8WO	0.9319
172	3M0	0.9318
173	3HA	0.9318
174	XQG	0.9317
175	HJP	0.9317
176	FOT	0.9317
177	1NP	0.9316
178	APZ	0.9316
179	I3A	0.9316
180	4YS	0.9314
181	1XN	0.9314
182	INE	0.9314
183	JBK	0.9311
184	SYV	0.9311
185	HMU	0.9311
186	8NX	0.9308
187	5XC	0.9307
188	2MI	0.9306
189	ES1	0.9305
190	7HQ	0.9303
191	MO8	0.9303
192	B53	0.9303
193	M1H	0.9303
194	2A9	0.9302
195	10L	0.9301
196	K3Q	0.9300
197	HPA	0.9298
198	FE DB1	0.9291
199	1LQ	0.9290
200	ORO	0.9289
201	N5J	0.9288
202	D07	0.9285
203	ADE	0.9284
204	7NI	0.9284
205	II6	0.9284
206	DBH	0.9283
207	3ID	0.9282
208	OXC	0.9279
209	JBH	0.9277
210	V55	0.9277
211	4CS	0.9276
212	KUF	0.9274
213	J6W	0.9274
214	B57	0.9273
215	UNC	0.9271
216	JPZ	0.9270
217	2A7	0.9268
218	82I	0.9268
219	92K	0.9266
220	7HP	0.9265
221	3NT	0.9265
222	J9Q	0.9263
223	MR1	0.9262
224	7WA	0.9261
225	KIA	0.9260
226	20J	0.9260
227	7ME	0.9258
228	ABV	0.9258
229	F9Y	0.9257
230	9HX	0.9256
231	NDM	0.9256
232	8CM	0.9255
233	B60	0.9255
234	5RO	0.9255
235	AHR	0.9255
236	P3K	0.9254
237	E7S	0.9254
238	DMD	0.9253
239	4AA	0.9253
240	QPR	0.9252
241	QWN	0.9251
242	JAE	0.9250
243	XIY	0.9249
244	MQN	0.9246
245	HLZ	0.9243
246	2FQ	0.9243
247	9DA	0.9242
248	4JQ	0.9241
249	DIU	0.9240
250	NMJ	0.9239
251	SHA	0.9238
252	2F6	0.9237
253	3Z8	0.9235
254	ADZ	0.9234
255	5GU	0.9234
256	8H8	0.9233
257	G3E	0.9233
258	6MP	0.9232
259	WCE	0.9232
260	0W8	0.9232
261	7W4	0.9231
262	CLZ	0.9231
263	QX2	0.9229
264	261	0.9227
265	1P7	0.9226
266	K22	0.9226
267	GAL	0.9223
268	N8Y	0.9222
269	8GC	0.9221
270	23A	0.9219
271	M1A	0.9218
272	5B1	0.9218
273	NID	0.9215
274	97T	0.9215
275	SWA	0.9215
276	2H5	0.9214
277	BTE	0.9212
278	UAN	0.9212
279	ES4	0.9211
280	F81	0.9211
281	Q6T	0.9211
282	XYP	0.9211
283	67N	0.9210
284	OVM	0.9208
285	4XH	0.9206
286	QWW	0.9204
287	3MB	0.9203
288	ISN	0.9203
289	5WV	0.9202
290	5WY	0.9202
291	PXL	0.9200
292	3HB	0.9200
293	42C	0.9199
294	GAB	0.9199
295	DOR	0.9197
296	BP1	0.9195
297	GDE	0.9193
298	PM6	0.9191
299	BRT	0.9191
300	C2U	0.9191
301	KYA	0.9191
302	TTL	0.9191
303	BEA	0.9189
304	SVN	0.9189
305	3MG	0.9189
306	IJZ	0.9188
307	QXW	0.9187
308	1M2	0.9187
309	6M9	0.9187
310	R8V	0.9187
311	F0J	0.9186
312	AW5	0.9182
313	3AB	0.9180
314	PRF	0.9180
315	KKN	0.9179
316	5RN	0.9179
317	Q71	0.9176
318	HH8	0.9175
319	5HN	0.9174
320	EUG	0.9174
321	9EW	0.9173
322	3BZ	0.9172
323	1LM	0.9170
324	BDP	0.9170
325	K32	0.9169
326	OVV	0.9167
327	4YO	0.9165
328	34D	0.9165
329	FDR	0.9165
330	DHK	0.9165
331	MAQ	0.9164
332	AKH	0.9161
333	TEP	0.9161
334	D1X	0.9161
335	B2J	0.9161
336	OW4	0.9160
337	24B	0.9160
338	KJH	0.9159
339	KDV	0.9159
340	069	0.9159
341	LXC	0.9159
342	3PF	0.9157
343	2FG	0.9157
344	2ZQ	0.9156
345	0RW	0.9154
346	7W1	0.9153
347	5RG	0.9153
348	1DW	0.9152
349	8ZE	0.9152
350	3Z7	0.9151
351	B5D	0.9150
352	PDC	0.9150
353	D48	0.9147
354	PXM	0.9147
355	HLR	0.9146
356	F05	0.9146
357	ZZ3	0.9146
358	R8S	0.9145
359	2LY	0.9142
360	4XR	0.9142
361	92P	0.9141
362	GJS	0.9141
363	JB5	0.9140
364	5QY	0.9140
365	Z5P	0.9138
366	JTH	0.9138
367	SXS	0.9137
368	ES7	0.9135
369	SE2	0.9134
370	PRZ	0.9134
371	FP1	0.9133
372	ICO	0.9132
373	KOJ	0.9129
374	12B	0.9127
375	4M4	0.9127
376	6CS	0.9127
377	KJY	0.9125
378	C2Y	0.9121
379	HHA	0.9120
380	0TU	0.9118
381	J5I	0.9118
382	12Q	0.9117
383	GZ8	0.9117
384	7ZE	0.9117
385	5UC	0.9116
386	TT4	0.9116
387	GZL	0.9115
388	6M4	0.9114
389	HQJ	0.9114
390	CTL	0.9114
391	AJV	0.9113
392	3IT	0.9113
393	4JT	0.9112
394	PYQ	0.9112
395	5WX	0.9112
396	GXY	0.9112
397	CTS	0.9110
398	M2K	0.9110
399	BPU	0.9109
400	UFO	0.9107
401	NSP	0.9106
402	SOE	0.9106
403	QAT	0.9105
404	N2I	0.9105
405	GIO	0.9104
406	149	0.9104
407	GM7	0.9103
408	JBE	0.9103
409	EMZ	0.9102
410	53C	0.9102
411	DBJ	0.9100
412	ASO	0.9100
413	SKA	0.9100
414	SX1	0.9097
415	R9Y	0.9097
416	X0W	0.9096
417	2FY	0.9096
418	0JD	0.9096
419	293	0.9096
420	NAG	0.9096
421	9KT	0.9095
422	GIV	0.9095
423	54G	0.9094
424	495	0.9092
425	5M0	0.9091
426	SAL	0.9091
427	MT0	0.9088
428	BE2	0.9087
429	GTQ	0.9083
430	5QX	0.9082
431	0F9	0.9082
432	4Z4	0.9080
433	HQT	0.9079
434	680	0.9078
435	HLD	0.9078
436	LGC	0.9078
437	VOH	0.9076
438	6KT	0.9074
439	3OC	0.9074
440	HHR	0.9073
441	5MK	0.9073
442	7WR	0.9072
443	URF	0.9070
444	EQT	0.9068
445	QUZ	0.9068
446	TDR	0.9068
447	TH7	0.9067
448	F12	0.9064
449	4BY	0.9064
450	4XV	0.9062
451	A13	0.9062
452	TSS	0.9062
453	717	0.9061
454	ADK	0.9060
455	3MA	0.9060
456	TH0	0.9060
457	YQA	0.9060
458	4FA	0.9059
459	ICP	0.9058
460	JBQ	0.9058
461	DFB	0.9058
462	OVP	0.9057
463	A29	0.9056
464	NPY	0.9051
465	IPB	0.9050
466	GLA	0.9050
467	52C	0.9050
468	TGX	0.9049
469	INO	0.9049
470	HZQ	0.9048
471	WBU	0.9047
472	JFJ	0.9046
473	1GN	0.9046
474	QAS	0.9045
475	0W1	0.9045
476	NGO	0.9045
477	BZI	0.9043
478	6NT	0.9043
479	E7Z	0.9042
480	3WA	0.9042
481	0HO	0.9041
482	8W9	0.9040
483	PEY	0.9040
484	428	0.9040
485	SHG	0.9040
486	1MC	0.9039
487	1PT	0.9038
488	P9P	0.9035
489	NDG	0.9035
490	4SV	0.9033
491	DHB	0.9031
492	ES6	0.9030
493	F31	0.9029
494	LI6	0.9028
495	7B3	0.9027
496	3U4	0.9027
497	K17	0.9024
498	E5X	0.9024
499	2BG	0.9023
500	QSH	0.9023
501	LDR	0.9022
502	9FL	0.9021
503	1F1	0.9020
504	G5V	0.9019
505	OMD	0.9019
506	0CT	0.9014
507	BMA	0.9014
508	SKM	0.9013
509	SWD	0.9012
510	BZF	0.9012
511	LSA	0.9012
512	ESI	0.9012
513	HIS	0.9012
514	2KA	0.9011
515	PFB	0.9011
516	PZI	0.9011
517	G2F	0.9011
518	4NC	0.9010
519	43M	0.9009
520	IND	0.9007
521	3NY	0.9006
522	CFF	0.9006
523	K37	0.9005
524	4JP	0.9004
525	32X	0.9004
526	FRU	0.9004
527	JLZ	0.9003
528	BR9	0.9002
529	GVH	0.9001
530	4XS	0.9000
531	5NI	0.9000
532	MCT	0.8999
533	JZ2	0.8998
534	NNO	0.8998
535	G6D	0.8998
536	1WD	0.8997
537	DEN	0.8997
538	0HN	0.8996
539	GRE	0.8996
540	XYD	0.8995
541	2ZM	0.8995
542	NTZ	0.8995
543	PYD	0.8993
544	2HU	0.8992
545	IFL	0.8991
546	MPI	0.8990
547	X05	0.8990
548	4ZC	0.8989
549	XM0	0.8989
550	2K8	0.8989
551	CH9	0.8989
552	4HO	0.8988
553	I6G	0.8988
554	39U	0.8988
555	MBG	0.8988
556	HX3	0.8987
557	3A9	0.8987
558	JIF	0.8986
559	LZ1	0.8985
560	NPO	0.8984
561	PKU	0.8983
562	9TZ	0.8983
563	DNA	0.8983
564	0R1	0.8982
565	UNJ	0.8982
566	JKE	0.8981
567	XBZ	0.8980
568	27Y	0.8979
569	4A3	0.8979
570	329	0.8977
571	9AP	0.8977
572	4CL	0.8975
573	4JJ	0.8975
574	JG8	0.8975
575	93K	0.8975
576	PD2	0.8975
577	SRO	0.8974
578	PQK	0.8974
579	MZG	0.8973
580	TOF	0.8972
581	2AC	0.8972
582	5MH	0.8972
583	4ZE	0.8972
584	12T	0.8971
585	DIE	0.8970
586	BK9	0.8969
587	3XX	0.8969
588	TBS	0.8968
589	GCU	0.8968
590	C9E	0.8967
591	MWM	0.8965
592	FBG	0.8965
593	6NI	0.8964
594	2MP	0.8963
595	2LP	0.8962
596	4JO	0.8962
597	IUR	0.8960
598	3ZB	0.8960
599	4BL	0.8960
600	34A	0.8960
601	275	0.8960
602	LDP	0.8960
603	DHQ	0.8960
604	GTR	0.8960
605	M2H	0.8957
606	JU2	0.8957
607	DNC	0.8955
608	M4E	0.8955
609	NOY	0.8954
610	MWJ	0.8953
611	LKA	0.8953
612	A1U	0.8952
613	QOS	0.8952
614	FUD	0.8952
615	ABI	0.8951
616	25W	0.8951
617	3FH	0.8949
618	BCU	0.8948
619	39A	0.8948
620	CKA	0.8948
621	L5V	0.8947
622	7WV	0.8947
623	W81	0.8947
624	XX2	0.8944
625	DNF	0.8944
626	42J	0.8943
627	51R	0.8943
628	TTY	0.8943
629	NDH	0.8942
630	7VJ	0.8942
631	3HM	0.8940
632	6F0	0.8940
633	PNZ	0.8940
634	TIU	0.8940
635	FGZ	0.8938
636	RSF	0.8938
637	2ZV	0.8937
638	LT2	0.8937
639	GIF	0.8936
640	ONR	0.8935
641	HNQ	0.8933
642	226	0.8932
643	MYJ	0.8930
644	T6C	0.8929
645	GOX	0.8928
646	DGJ	0.8928
647	1KP	0.8927
648	F5B	0.8927
649	HBA	0.8927
650	8XQ	0.8927
651	JZ3	0.8926
652	PHB	0.8925
653	37T	0.8924
654	DHR	0.8923
655	PX7	0.8922
656	3R6	0.8921
657	X09	0.8920
658	3QV	0.8919
659	BZ2	0.8919
660	A7H	0.8918
661	BHO	0.8918
662	H5B	0.8917
663	FLV	0.8917
664	HHS	0.8916
665	ANN	0.8915
666	TM7	0.8914
667	MAN	0.8912
668	GLY PRO	0.8912
669	35C	0.8911
670	JB8	0.8911
671	VXX	0.8910
672	5JC	0.8909
673	15E	0.8909
674	IDM	0.8909
675	6M1	0.8907
676	GYE	0.8907
677	DRG	0.8906
678	FHB	0.8906
679	7MX	0.8906
680	JAW	0.8905
681	YRL	0.8904
682	30G	0.8904
683	JDN	0.8903
684	0R0	0.8902
685	PHT	0.8901
686	173	0.8901
687	2CK	0.8900
688	7MH	0.8899
689	YSO	0.8899
690	15N	0.8899
691	2YU	0.8898
692	GAF	0.8898
693	NIZ	0.8897
694	2HO	0.8896
695	9CA	0.8896
696	CHB	0.8895
697	TFU	0.8894
698	0GZ	0.8891
699	9TW	0.8891
700	0FK	0.8891
701	3AL	0.8891
702	SOR	0.8891
703	NTM	0.8890
704	Q7A	0.8888
705	XYS	0.8888
706	AGK	0.8887
707	IUP	0.8887
708	E35	0.8886
709	X6X	0.8886
710	GBD	0.8884
711	KTW	0.8883
712	Z82	0.8883
713	NVU	0.8883
714	EVA	0.8882
715	8G0	0.8881
716	AA	0.8880
717	P84	0.8880
718	FUL	0.8880
719	RPQ	0.8879
720	RD4	0.8879
721	1AL	0.8878
722	IHB	0.8878
723	344	0.8877
724	HT4	0.8877
725	ZVO	0.8876
726	IF7	0.8876
727	4VS	0.8876
728	ALL	0.8875
729	DPZ	0.8874
730	1WG	0.8874
731	PAB	0.8874
732	4KL	0.8874
733	1IT	0.8873
734	ISZ	0.8870
735	LYL	0.8869
736	ICB	0.8869
737	OW7	0.8868
738	WOO	0.8866
739	AEF	0.8866
740	EJZ	0.8866
741	OA3	0.8865
742	E1T	0.8864
743	2CQ	0.8864
744	ZZ8	0.8864
745	DBX	0.8862
746	6TZ	0.8862
747	0FN	0.8861
748	HKD	0.8861
749	QSB	0.8858
750	TLD	0.8857
751	4VP	0.8857
752	GXL	0.8857
753	K5W	0.8853
754	K82	0.8852
755	GCB	0.8852
756	FH2	0.8851
757	BEZ	0.8851
758	JZ9	0.8850
759	K8X	0.8847
760	8NB	0.8847
761	TXW	0.8845
762	4VY	0.8845
763	G12	0.8843
764	1X7	0.8843
765	1P3	0.8843
766	IFM	0.8842
767	X8D	0.8841
768	15L	0.8838
769	Y8I	0.8837
770	OXQ	0.8837
771	HBD	0.8837
772	JP2	0.8836
773	NGT	0.8836
774	CFI	0.8836
775	TYL	0.8835
776	XXR	0.8833
777	AZF	0.8833
778	6UA	0.8832
779	BEN	0.8832
780	PFL	0.8832
781	BAM	0.8831
782	1Y6	0.8830
783	AX2	0.8830
784	GOJ	0.8829
785	9ZE	0.8828
786	RIP	0.8828
787	IDH	0.8828
788	JR2	0.8828
789	NK	0.8826
790	JFD	0.8823
791	GAG	0.8823
792	R20	0.8822
793	SR1	0.8817
794	MNM	0.8816
795	BZJ	0.8815
796	OXZ	0.8815
797	BDF	0.8815
798	7I2	0.8813
799	150	0.8813
800	GJP	0.8813
801	MWP	0.8812
802	6FZ	0.8812
803	KLW	0.8811
804	3SK	0.8811
805	ZYR	0.8810
806	GVG	0.8810
807	F2W	0.8809
808	BSX	0.8808
809	174	0.8808
810	FA3	0.8807
811	APS	0.8806
812	TBP	0.8806
813	FDK	0.8804
814	G4D	0.8804
815	JUG	0.8802
816	FUC	0.8802
817	4MA	0.8801
818	6BL	0.8801
819	0MK	0.8801
820	KBG	0.8800
821	FBU	0.8799
822	FBW	0.8798
823	4P5	0.8797
824	AIN	0.8797
825	NCA	0.8796
826	DEE	0.8796
827	OKM	0.8795
828	EOL	0.8794
829	VNJ	0.8794
830	PBZ	0.8793
831	P9E	0.8793
832	EN1	0.8793
833	IFP	0.8792
834	THA	0.8792
835	8HC	0.8791
836	ZWZ	0.8790
837	ANF	0.8790
838	Q77	0.8790
839	V6F	0.8790
840	H8N	0.8789
841	PEA	0.8789
842	LCN	0.8788
843	826	0.8788
844	YIO	0.8788
845	ZZZ	0.8787
846	CFA	0.8787
847	2DR	0.8787
848	R8A	0.8786
849	YCP	0.8786
850	NSG	0.8785
851	NBZ	0.8784
852	DX3	0.8784
853	N2Z	0.8782
854	GNL	0.8781
855	PHH	0.8781
856	EYK	0.8781
857	60P	0.8781
858	549	0.8781
859	HA7	0.8781
860	PA1	0.8781
861	HBO	0.8780
862	FBM	0.8779
863	AY4	0.8776
864	4RU	0.8775
865	5ZE	0.8774
866	67X	0.8774
867	HXX	0.8772
868	23J	0.8771
869	H7Y	0.8770
870	DMJ	0.8770
871	ESP	0.8770
872	6PC	0.8770
873	12M	0.8770
874	G1O	0.8769
875	OTR	0.8769
876	FPY	0.8769
877	GT0	0.8769
878	SW7	0.8768
879	GV9	0.8768
880	AJY	0.8768
881	NIO	0.8768
882	UFV	0.8768
883	7FF	0.8766
884	ZB1	0.8764
885	ARB	0.8764
886	1HN	0.8762
887	ADA	0.8761
888	BR8	0.8760
889	286	0.8760
890	C2A	0.8760
891	PJW	0.8760
892	13X	0.8759
893	O2A	0.8758
894	DFU	0.8758
895	EKZ	0.8758
896	3BU	0.8758
897	JXN	0.8757
898	39O	0.8756
899	ASC	0.8756
900	45L	0.8756
901	1A7	0.8755
902	RIB	0.8755
903	KFH	0.8755
904	6LW	0.8754
905	45C	0.8754
906	3AY	0.8754
907	KYD	0.8754
908	FA1	0.8754
909	AC6	0.8751
910	MJ2	0.8751
911	PZA	0.8749
912	NGW	0.8748
913	5AN	0.8748
914	PYG	0.8748
915	0XT	0.8747
916	GCO	0.8747
917	GNM	0.8744
918	K25	0.8742
919	F4Z	0.8741
920	PHU	0.8741
921	3DO	0.8740
922	NGA	0.8740
923	INS	0.8740
924	47J	0.8737
925	ROI	0.8737
926	14J	0.8736
927	J01	0.8736
928	GHM	0.8735
929	DUB	0.8735
930	N3W	0.8735
931	5NE	0.8734
932	RAM	0.8733
933	6MH	0.8732
934	RB5	0.8732
935	HA5	0.8732
936	4JM	0.8730
937	F1A	0.8729
938	DA4	0.8729
939	CN0	0.8728
940	IQ5	0.8728
941	GF4	0.8728
942	HHT	0.8728
943	OAA	0.8726
944	N7I	0.8723
945	SG2	0.8722
946	2C9	0.8722
947	TC7	0.8721
948	MBD	0.8720
949	FAN	0.8719
950	GIM	0.8718
951	A65	0.8718
952	LNR	0.8717
953	H76	0.8717
954	NTN	0.8717
955	IAC	0.8717
956	2MY	0.8716
957	K6X	0.8715
958	GMN	0.8715
959	7D2	0.8715
960	J9N	0.8715
961	NFM	0.8714
962	P72	0.8712
963	HY3	0.8711
964	MFB	0.8709
965	HTP	0.8709
966	GSY	0.8708
967	FBT	0.8708
968	SF9	0.8707
969	8OZ	0.8707
970	A2G	0.8706
971	TM4	0.8705
972	OTD	0.8705
973	ARP	0.8704
974	XCZ	0.8704
975	MVL	0.8704
976	AEH	0.8703
977	VGL	0.8703
978	2CM	0.8702
979	BPY	0.8701
980	V1T	0.8700
981	3CE	0.8699
982	3MC	0.8699
983	EXO	0.8699
984	ERH	0.8698
985	RHU	0.8698
986	AEZ	0.8698
987	URQ	0.8697
988	PHE	0.8696
989	RM4	0.8695
990	IPZ	0.8694
991	0TR	0.8693
992	3FA	0.8693
993	JKZ	0.8693
994	4NM	0.8692
995	WDL	0.8692
996	FCA	0.8691
997	4I8	0.8691
998	NLA	0.8691
999	FCB	0.8688
1000	2ZX	0.8687
1001	FFP	0.8687
1002	ZXD	0.8686
1003	3R4	0.8685
1004	S0E	0.8684
1005	2GS	0.8680
1006	EXD	0.8680
1007	259	0.8680
1008	4WL	0.8680
1009	RBL	0.8680
1010	23W	0.8680
1011	XRG	0.8679
1012	6OT	0.8679
1013	8XL	0.8679
1014	091	0.8678
1015	MS0	0.8678
1016	0LH	0.8677
1017	SNO	0.8677
1018	9FE	0.8676
1019	FUF	0.8676
1020	FB1	0.8676
1021	L99	0.8673
1022	GTZ	0.8673
1023	X0V	0.8673
1024	XUL	0.8672
1025	GOO	0.8672
1026	EUE	0.8669
1027	IWT	0.8668
1028	68A	0.8668
1029	RNS	0.8668
1030	ESX	0.8667
1031	LT8	0.8667
1032	4ZA	0.8665
1033	UNU	0.8663
1034	M4T	0.8662
1035	AC0	0.8662
1036	27B	0.8659
1037	463	0.8657
1038	94N	0.8657
1039	HFB	0.8656
1040	LMR	0.8655
1041	IBF	0.8655
1042	49O	0.8655
1043	FQI	0.8654
1044	FLM	0.8654
1045	PBC	0.8650
1046	F4E	0.8649
1047	06B	0.8648
1048	TPA	0.8648
1049	7CZ	0.8646
1050	1U6	0.8646
1051	1U1	0.8644
1052	F9P	0.8644
1053	CRS	0.8644
1054	L3Q	0.8640
1055	2HC	0.8636
1056	FBV	0.8633
1057	5LA	0.8633
1058	BBF	0.8633
1059	GOG	0.8632
1060	4FH	0.8631
1061	2MN	0.8630
1062	ABE	0.8630
1063	6Q3	0.8627
1064	RCO	0.8626
1065	BCF	0.8620
1066	KP6	0.8619
1067	SYN	0.8619
1068	DQA	0.8614
1069	FBA	0.8608
1070	HBX	0.8607
1071	KTJ	0.8605
1072	IP0	0.8605
1073	HPT	0.8602
1074	DQN	0.8600
1075	4V2	0.8599
1076	1DV	0.8599
1077	TCZ	0.8598
1078	2JK	0.8596
1079	AN3	0.8596
1080	FPK	0.8595
1081	VM1	0.8594
1082	BNT	0.8590
1083	X0U	0.8589
1084	GLT	0.8587
1085	PZM	0.8585
1086	LPK	0.8583
1087	60Q	0.8582
1088	3CH	0.8578
1089	282	0.8575
1090	SF6	0.8575
1091	MT5	0.8572
1092	DK1	0.8570
1093	F3B	0.8566
1094	HGQ	0.8558
1095	URA	0.8554
1096	B3R	0.8550
1097	B56	0.8550
1098	DHS	0.8544
1099	3MH	0.8542
1100	GO8	0.8541
1101	WOT	0.8540
1102	BVF	0.8531
1103	4H2	0.8529
1104	9LI	0.8528
1105	M3T	0.8528
1106	CYT	0.8521
1107	HEW	0.8510
1108	LG5	0.8506

Similar Binding Sites (Proteins are less than 50% similar to leader)

Pocket No.: 1; Query (leader) PDB : 4UYE; Ligand: 9F9; Similar sites found with APoc: 4

This union binding pocket(no: 1) in the query (biounit: 4uye.bio1) has 19 residues
No:	Leader PDB	Ligand	Sequence Similarity
1	4YC9	4C1	35.5932
2	6J3O	B4L	38.1356
3	5MLJ	9ST	40.1786
4	5ML0	P2L	45.4545

Pocket No.: 2; Query (leader) PDB : 4UYE; Ligand: 9F9; Similar sites found with APoc: 7

This union binding pocket(no: 2) in the query (biounit: 4uye.bio2) has 16 residues
No:	Leader PDB	Ligand	Sequence Similarity
1	6J3P	B8O	38.1356
2	6J3O	B4L	38.1356
3	6J3P	B8O	38.1356
4	5TPX	7H7	38.9831
5	5MLJ	9ST	40.1786
6	5MLJ	9ST	40.1786
7	5ML0	P2L	45.4545

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